Chemical Compound

Stachybocin B

CAS Registry Number 158827-61-3
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Stachybocin B chemical structure
Primary Record

Stachybocin B

In stock
4,826 g
Purity
98.2 %
CAS
158827-61-3

Compound Identifiers & Properties

CAS
158827-61-3
PubChem CID
10509958
SMILES
C[C@@H]1CCC2[C@@]([C@@]13CC4=C(C=C5C(=C4O3)CN(C5=O)CCCC[C@@H](C(=O)O)N6CC7=C8C(=C(C=C7C6=O)O)C[C@@]9(O8)[C@@H](CCC1[C@@]9(C[C@H]([C@H](C1(C)C)O)O)C)C)O)(CC[C@H](C2(C)C)O)C
Canonical SMILES
C[C@@H]1CCC2C(C)(C)[C@H](O)CC[C@]2(C)[C@@]12Cc1c(O)cc3c(c1O2)CN(CCCC[C@@H](C(=O)O)N1Cc2c(cc(O)c4c2O[C@]2(C4)[C@H](C)CCC4C(C)(C)[C@H](O)[C@H](O)C[C@@]42C)C1=O)C3=O

Names & Synonyms

  • Stachybocin B
  • STB B
  • RefChem:185261
  • DTXSID90891848
  • SCHEMBL29711447
  • CHEBI:213479
  • DTXCID301031269
  • BBF-02951
  • CID10509958
  • CID 10509958
  • J707.896J
  • NS00094917
  • 158827-61-3
  • (2S)-6-[(3R,7R,8R,8aS)-3,4'-dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl]-2-[(2R,3S,7R,8R,8aS)-2,3,4'-trihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl]hexanoic acid
  • (2S)-2-[(2R,2'R,6'S,7'R,8'aS)-4,6',7'-trihydroxy-2',5',5',8'a-tetramethyl-6-oxo-3,3',4',4'a,5',6,6',7,7',8,8',8'a-dodecahydro-2'H-spiro[furo[2,3-e]isoindole-2,1'-naphthalen]-7-yl]-6-[(2R,2'R,6'R,8'aS)-4,6'-dihydroxy-2',5',5',8'a-tetramethyl-6-oxo-3,3',4',4'a,5',6,6',7,7',8,8',8'a-dodecahydro-2'H-spiro[furo[2,3-e]isoindole-2,1'-naphthalen]-7-yl]hexanoic acid
  • (2S)-2-[[(2R)-2 alpha,5 ,5 ,8a beta-Tetramethyl-4,6 alpha,7 alpha-trihydroxy-6-oxo-6,8-dihydrospiro[2H-1-oxa-7-aza-as-indacene-2,1 -decalin]]-7(3H)-yl]-6-[[(2R)-2 alpha,5 ,5 ,8a beta-tetramethyl-4,6 alpha-dihydroxy-6-oxo-6,8-dihydrospiro[2H-1-oxa-7-aza-as-indacene-2,1 -decalin]]-7(3H)-yl]hexanoic acid
  • (2S)-6-((3R,7R,8R,8aS)-3,4'-dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro(2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro(2,3-e)isoindole)-7'-yl)-2-((2R,3S,7R,8R,8aS)-2,3,4'-trihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro(2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro(2,3-e)isoindole)-7'-yl)hexanoic acid
  • (2S)-6-[(1'R,2'R,6'R,8'aS)-4,6'-Dihydroxy-2',5',5',8'a-tetramethyl-6-oxo-3',4',4'a,5',6,6',7',8,8',8'a-decahydro-2'H-spiro[furo[2,3-e]isoindole-2,1'-naphthalen]-7(3H)-yl]-2-[(1'R,2'R,6'S,7'R,8'aS)-4,6',7'-trihydroxy-2',5',5',8'a-tetramethyl-6-oxo-3',4',4'a,5',6,6',7',8,8',8'a-decahydro-2'H-spiro[furo[2,3-e]isoindole-2,1'-naphthalen]-7(3H)-yl]hexanoic acid
  • (2S)-6-[(3R,7R,8R,8aS)-3,4'-dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrouro[2,3-e]isoindole]-7'-yl]-2-[(2R,3S,7R,8R,8aS)-2,3,4'-trihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrouro[2,3-e]isoindole]-7'-yl]hexanoic acid
  • 6-(3,4'-dihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl)-2-(2,3,4'-trihydroxy-4,4,7,8a-tetramethyl-6'-oxospiro[2,3,4a,5,6,7-hexahydro-1H-naphthalene-8,2'-3,8-dihydrofuro[2,3-e]isoindole]-7'-yl)hexanoic acid
  • Spiro[2H-furo[2,3-e]isoindole-2,1'(2'H)-naphthalene]-7(3H)-hexanoic acid, a-[(1'R,2'R,4'aS,6'S,7'R,8'aS)-3',4',4'a,5',6,6',7',8,8',8'a-decahydro-4,6',7'-trihydroxy-2',5',5',8'a-tetramethyl-6-oxospiro[2H-furo[2,3-e]isoindole-2,1'(2'H)-naphthalen]-7(3H)-yl]-3',4',4'a,5',6,6',7',8,8',8'a-decahydro-4,6'-dihydroxy-2',5',5',8'a-tetramethyl-6-oxo-, (aS,1'R,2'R,4'aS,6'R,8'aS)-