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esculeogenin A

PropertiesImageOccurences in reactions
MNX_IDMNXM104936Image of MNXM104936
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC27H45NO4
charge0
mass447.33486
referencechebi:71676
InChIKeyFBKQAVWTYDQPAB-HBDLFPIVSA-N
InChIInChI=1S/C27H45NO4/c1-15-24-22(32-27(15)23(31)10-16(14-29)13-28-27)12-21-19-5-4-17-11-18(30)6-8-25(17,2)20(19)7-9-26(21,24)3/h15-24,28-31H,4-14H2,1-3H3/t15-,16-,17-,18-,19+,20-,21-,22-,23-,24-,25-,26-,27-/m0/s1
SMILESC[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC[C@H]5C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@@]32C)O[C@@]12NC[C@@H](CO)C[C@@H]2O
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:71676
chebi:71676
esculeogenin A
(3beta,5alpha,22alpha,23S,25S)-spirosolane-3,23,27-triol