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Details

Stereochemistry ABSOLUTE
Molecular Formula C30H54O5
Molecular Weight 494.7468
Optical Activity UNSPECIFIED
Defined Stereocenters 11 / 11
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DAMMARANE-3,12,20,24,25-PENTOL, (3.BETA.,12.BETA.,24S)-

SMILES

CC(C)(O)[C@@H](O)CC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]23C

InChI

InChIKey=ROUZPBFWHICWJH-BVGXOPESSA-N
InChI=1S/C30H54O5/c1-25(2)20-10-15-28(6)21(27(20,5)13-11-22(25)32)17-19(31)24-18(9-14-29(24,28)7)30(8,35)16-12-23(33)26(3,4)34/h18-24,31-35H,9-17H2,1-8H3/t18-,19+,20-,21+,22-,23-,24-,27-,28+,29+,30-/m0/s1

HIDE SMILES / InChI

Molecular Formula C30H54O5
Molecular Weight 494.7468
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 11 / 11
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 09:24:26 GMT 2025
Edited
by admin
on Wed Apr 02 09:24:26 GMT 2025
Record UNII
PD8AMQ2AZ7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(20S)-PROTOPANAXADIOL METABOLITE M6-1
Preferred Name English
DAMMARANE-3,12,20,24,25-PENTOL, (3.BETA.,12.BETA.,24S)-
Common Name English
(3S,6S)-6-((3S,5R,8R,9R,10R,12R,13R,14R,17S)-3,12-DIHYDROXY-4,4,8,10,14-PENTAMETHYL-2,3,5,6,7,9,11,12,13,15,16,17-DODECAHYDRO-1H-CYCLOPENTA(A)PHENANTHREN-17-YL)-2-METHYL-HEPTANE-2,3,6-TRIOL
Systematic Name English
Code System Code Type Description
FDA UNII
PD8AMQ2AZ7
Created by admin on Wed Apr 02 09:24:26 GMT 2025 , Edited by admin on Wed Apr 02 09:24:26 GMT 2025
PRIMARY
PUBCHEM
118753110
Created by admin on Wed Apr 02 09:24:26 GMT 2025 , Edited by admin on Wed Apr 02 09:24:26 GMT 2025
PRIMARY
Related Record Type Details
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