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17-Norkaur-15-ene-13-carboxylic acid, 3,19-dihydroxy-, (3.alpha.,4.alpha.,8.beta.,13.beta.)-
SpectraBase Compound ID 8iVqBnQ4hSL
InChI InChI=1S/C20H30O4/c1-17-6-5-15(22)18(2,12-21)13(17)3-7-19-9-10-20(11-19,16(23)24)8-4-14(17)19/h9-10,13-15,21-22H,3-8,11-12H2,1-2H3,(H,23,24)/t13-,14-,15-,17+,18-,19+,20+/m1/s1
InChIKey NHIZKJCSMHIDMN-BHJGDWCPSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGgokhPF4y8
Name 17-Norkaur-15-ene-13-carboxylic acid, 3,19-dihydroxy-, (3.alpha.,4.alpha.,8.beta.,13.beta.)-
CAS Registry Number 82053-52-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-17-6-5-15(22)18(2,12-21)13(17)3-7-19-9-10-20(11-19,16(23)24)8-4-14(17)19/h9-10,13-15,21-22H,3-8,11-12H2,1-2H3,(H,23,24)/t13-,14-,15-,17+,18-,19+,20+/m1/s1
InChIKey NHIZKJCSMHIDMN-BHJGDWCPSA-N
Molecular Weight 334.456 g/mol
SMILES OC[C@@]1([C@]2([C@](CC[C@]1(O)[H])([C@@]1([C@]3(CC2)C[C@@](CC1)(C(=O)O)C=C3)[H])C)[H])C
SPLASH splash10-001r-0029000000-b3e41d5882848bd832ef
Source of Spectrum B-35-617-0
Synonyms (3alpha,4beta,5alpha,9alpha,10beta)-3,18-dihydroxystach-15-en-17-oic acid 1H-2,10a-ethenophenanthrene, 17-norkaur-15-ene-13-carboxylic acid deriv. 1H-2,10a-ethenophenanthrene-2(3H)-carboxylic acid, 4,4a,4b,5,6,7,8,8a.alpha.,9,10-decahydro-7-hydroxy-8-(hydroxymethyl)- 4b.beta.,8-dimethyl- ent-3.alpha.,19-dihydroxybeyer-15-en-19-oic acid
Wiley ID 1331109