Chemical Compound

(6R,7E)-6-methyl-8-[(1S,4Z,6Z,8E,10R,12R,14R,16S,17E,20R,21R,22S,24R,25S,26S,27E,31E,34S,36S,40R)-22,25,26-trihydroxy-21,40-dimethyl-3-oxo-2,11,15,35,39-pentaoxapentacyclo[32.2.2.1~12,16~.1~20,24~.0~10,14~]tetraconta-4,6,8,17,27,31,37-heptaen-36-yl]non-7-enoic acid (non-preferred name)

CAS Registry Number 100415-25-6
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(6R,7E)-6-methyl-8-[(1S,4Z,6Z,8E,10R,12R,14R,16S,17E,20R,21R,22S,24R,25S,26S,27E,31E,34S,36S,40R)-22,25,26-trihydroxy-21,40-dimethyl-3-oxo-2,11,15,35,39-pentaoxapentacyclo[32.2.2.1~12,16~.1~20,24~.0~10,14~]tetraconta-4,6,8,17,27,31,37-heptaen-36-yl]non-7-enoic acid (non-preferred name) 结构式
Primary record

(6R,7E)-6-methyl-8-[(1S,4Z,6Z,8E,10R,12R,14R,16S,17E,20R,21R,22S,24R,25S,26S,27E,31E,34S,36S,40R)-22,25,26-trihydroxy-21,40-dimethyl-3-oxo-2,11,15,35,39-pentaoxapentacyclo[32.2.2.1~12,16~.1~20,24~.0~10,14~]tetraconta-4,6,8,17,27,31,37-heptaen-36-yl]non-7-enoic acid (non-preferred name)

库存
6,897 克
纯度
99.2 %
CAS
100415-25-6

化合物标识与属性

CAS
100415-25-6
PubChem CID
657059
SMILES
C[C@H]1[C@H]2C/C=C/[C@H]3[C@@H]([C@H]4C[C@@H](O3)[C@H](O4)/C=C/C=C\C=C/C(=O)O[C@H]5C=C[C@H](C/C=C/CC/C=C/[C@@H]([C@@H]([C@H](O2)C[C@@H]1O)O)O)O[C@H]5/C(=C/[C@H](C)CCCCC(=O)O)/C)C
Canonical SMILES
C/C(=C\[C@H](C)CCCCC(=O)O)[C@@H]1O[C@@H]2C=C[C@@H]1OC(=O)/C=C\C=C/C=C/[C@H]1O[C@@H]3C[C@H]1O[C@@H](/C=C/C[C@H]1O[C@H](C[C@H](O)[C@H]1C)[C@@H](O)[C@@H](O)/C=C/CC/C=C/C2)[C@@H]3C

名称与同义词

  • Sorangicin A
  • Sorangicin-A
  • (+)-Sorangicin A
  • RefChem:184379
  • SCHEMBL29385366
  • GTPL11038
  • OTABDKFPJQZJRD-QLGZCQHWSA-N
  • DTXSID001054535
  • Q27465466
  • SRN
  • (6R,7E)-6-methyl-8-[(1S,4Z,6Z,8E,10R,12R,14R,16S,17E,20R,21R,22S,24R,25S,26S,27E,31E,34S,36S,40R)-22,25,26-trihydroxy-21,40-dimethyl-3-oxo-2,11,15,35,39-pentaoxapentacyclo[32.2.2.1~12,16~.1~20,24~.0~10,14~]tetraconta-4,6,8,17,27,31,37-heptaen-36-yl]non-7-enoic acid (non-preferred name)
  • (E)-6-methyl-8-((4Z,6Z,8E,10R,12R,14R,16S,17E,22S,24R,27E,31E,40R)-22,25,26-trihydroxy-21,40-dimethyl-3-oxo-2,11,15,35,39-pentaoxapentacyclo(32.2.2.112,16.120,24.010,14)tetraconta-4,6,8,17,27,31,37-heptaen-36-yl)non-7-enoic acid
  • (E,6R)-6-methyl-8-((1S,4Z,6Z,8E,10R,12R,14R,16S,17E,20R,21R,22S,24R,25S,26S,27E,31E,34S,36S,40R)-22,25,26-trihydroxy-21,40-dimethyl-3-oxo-2,11,15,35,39-pentaoxapentacyclo(32.2.2.112,16.120,24.010,14)tetraconta-4,6,8,17,27,31,37-heptaen-36-yl)non-7-enoic acid
  • 100415-25-6