Chemical Compound

(2R,3R,3''R,5'S,5''S,6'S,8'R,9'R,10'S,11'S,12'S,14'S,17'R,20'S,26'S,27'S,30'R,34'S,35'R,39'R,42'S)-3,3'',8',10'-tetrahydroxy-5''-(hydroxymethyl)-5,5',5'',9',11',26',34'-heptamethyldispiro[oxane-2,33'-[13,32]dioxa-[2,23]diazatridecacyclo[21.20.0.01,24.02,24.03,22.05,20.06,17.09,16.010,14.026,42.027,39.030,35.030,38]tritetracontane-12',2''-oxolane]-3'(22'),15',37'-trien-29'-one

(2R,3R,3''R,5'S,5''S,6'S,8'R,9'R,10'S,11'S,12'S,14'S,17'R,20'S,26'S,27'S,30'R,34'S,35'R,39'R,42'S)-3,3'',8',10'-tetrahydroxy-5''-(hydroxymethyl)-5,5',5'',9',11',26',34'-heptamethyldispiro[oxane-2,33'-[13,32]dioxa-[2,23]diazatridecacyclo[21.20.0.01,24.02,24.03,22.05,20.06,17.09,16.010,14.026,42.027,39.030,35.030,38]tritetracontane-12',2''-oxolane]-3'(22'),15',37'-trien-29'-one 结构式
Primary record

(2R,3R,3''R,5'S,5''S,6'S,8'R,9'R,10'S,11'S,12'S,14'S,17'R,20'S,26'S,27'S,30'R,34'S,35'R,39'R,42'S)-3,3'',8',10'-tetrahydroxy-5''-(hydroxymethyl)-5,5',5'',9',11',26',34'-heptamethyldispiro[oxane-2,33'-[13,32]dioxa-[2,23]diazatridecacyclo[21.20.0.01,24.02,24.03,22.05,20.06,17.09,16.010,14.026,42.027,39.030,35.030,38]tritetracontane-12',2''-oxolane]-3'(22'),15',37'-trien-29'-one

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
101040666
SMILES
C[C@H]1[C@H]2CC=C3[C@]2(CO[C@@]14[C@@H](CC(CO4)C)O)C(=O)C[C@H]5[C@H]3CC[C@@H]6[C@@]5(CC78C9(C6)N7C1=C(N98)C[C@]2([C@H](C1)CC[C@@H]1[C@@H]2C[C@H]([C@]2(C1=C[C@H]1[C@@]2([C@@H]([C@@]2(O1)[C@@H](C[C@@](O2)(C)CO)O)C)O)C)O)C)C
Canonical SMILES
CC1CO[C@]2(OC[C@]34C(=O)C[C@H]5[C@@H](CC[C@H]6CC78N9C%10=C(C[C@@]%11(C)[C@@H](CC[C@H]%12C%13=C[C@@H]%14O[C@]%15(O[C@](C)(CO)C[C@H]%15O)[C@@H](C)[C@]%14(O)[C@@]%13(C)[C@H](O)C[C@@H]%12%11)C%10)N7C98C[C@@]65C)C3=CC[C@@H]4[C@@H]2C)[C@H](O)C1

名称与同义词

  • Cephalostatin 1
  • J1.176.337E
  • (22R,23R)-2,2,3,3-[[(22S,23R,25S)-12beta,17,23,26-Tetrahydroxy-16beta,22:22,25-diepoxy-5alpha-cholesta-2,14-diene-3,2-diyl]bisnitrilo]-23-hydroxy-18,22:22,26-diepoxy-5alpha-cholest-14-en-12-one
  • (2R,3R,3''R,5'S,5''S,6'S,8'R,9'R,10'S,11'S,12'S,14'S,17'R,20'S,26'S,27'S,30'R,34'S,35'R,39'R,42'S)-3,3'',8',10'-tetrahydroxy-5''-(hydroxymethyl)-5,5',5'',9',11',26',34'-heptamethyldispiro[oxane-2,33'-[13,32]dioxa-[2,23]diazatridecacyclo[21.20.0.01,24.02,24.03,22.05,20.06,17.09,16.010,14.026,42.027,39.030,35.030,38]tritetracontane-12',2''-oxolane]-3'(22'),15',37'-trien-29'-one