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(2beta,3beta,5beta,6E,9xi,17xi)-6-(hydroxyimino)cholest-7-ene-2,3,14,20,22,25-hexol

Catalog ID
STL002813
SMILES O/N=C/1\C=C2C([C@@]3([C@H]1C[C@@H](O)[C@H](C3)O)C)CC[C@]1([C@@]2(O)CCC1[C@](C(CCC(O)(C)C)O)(O)C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H45NO7 MW 495.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H45NO7/c1-23(2,32)9-8-22(31)26(5,33)21-7-11-27(34)16-12-18(28-35)17-13-19(29)20(30)14-24(17,3)15(16)6-10-25(21,27)4/h12,15,17,19-22,29-35H,6-11,13-14H2,1-5H3/b28-18+/t15?,17-,19+,20-,21?,22?,24+,25+,26+,27+/m0/s1
InChIKey
CBQFTGKSOCYQEV-DTJPZRLDSA-N
Synonyms

(2beta3beta5beta6E9xi17xi)6(hydroxyimino)cholest7ene2314202225hexol
(2S3R5R10R13R14S)2314trihydroxy1013dimethyl17((2R)236trihydroxy6methylheptan2yl)2345911121314151617dodecahydro1Hcyclopenta(a)phenanthren6(10H)oneoxime
(2S3R5R6E10R13R14S)6hydroxyimino1013dimethyl17((2R)236trihydroxy6methylheptan2yl)234591112151617decahydro1Hcyclopenta(a)phenanthrene2314triol
CC12CCC3C(=CC(=NO)C4C3(CC(C(C4)O)O)C)C1(CCC2C(C)(C(CCC(C)(C)O)O)O)O
InChI=1SC27H45NO7c123(232)9822(31)26(533)2171127(34)161218(2835)171319(29)20(30)1424(173)15(16)61025(2127)4h12151719222935H6111314H215H3b2818+t15?1719+2021?22?24+25+26+27+m0s1
MFCD06492611
ON=C1C=C2C((C@@)3((C@H)1C(C@@H)(O)(C@H)(C3)O)C)CC(C@)1((C@@)2(O)CCC1(C@)(C(CCC(O)(C)C)O)(O)C)C
ZINC000253498594
ZINC000253498601

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Available files

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