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Amarosterol-B [13,14-seco-Stigma-9(11),14(15)-diene-3-.alpha.-ol]
SpectraBase Compound ID D4h0x7xk7dK
InChI InChI=1S/C29H50O/c1-7-23(20(2)3)13-11-21(4)27-10-8-9-24-14-15-25-19-26(30)17-18-29(25,6)28(24)16-12-22(27)5/h8-9,16,20-27,30H,7,10-15,17-19H2,1-6H3/b9-8+,28-16+/t21-,22+,23?,24?,25?,26-,27?,29+/m1/s1
InChIKey HKYYLANUJNZBFK-WDKLOZMUSA-N
Mol Weight 414.7 g/mol
Molecular Formula C29H50O
Exact Mass 414.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jZbJcTPFY
Name Amarosterol-B [13,14-seco-Stigma-9(11),14(15)-diene-3-.alpha.-ol]
Alternate Name(s) Amarosterol-B2 (3R,7E,11S,13E,13bS)-10-((2R)-5-ethyl-6-methylheptan-2-yl)-11,13b-dimethyl-2,3,4,4a,5,6,6a,9,10,11,12,13b-dodecahydro-1H-cyclonona[a]naphthalen-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H50O
InChI InChI=1S/C29H50O/c1-7-23(20(2)3)13-11-21(4)27-10-8-9-24-14-15-25-19-26(30)17-18-29(25,6)28(24)16-12-22(27)5/h8-9,16,20-27,30H,7,10-15,17-19H2,1-6H3/b9-8+,28-16+/t21-,22+,23?,24?,25?,26-,27?,29+/m1/s1
InChIKey HKYYLANUJNZBFK-WDKLOZMUSA-N
Molecular Weight 414.718 g/mol
SMILES O[C@@]1(CC[C@@]2(\C3=C\C[C@@](C([C@@](CCC(C(C)C)CC)(C)[H])C\C=C\C3CCC2C1)(C)[H])C)[H]
SPLASH splash10-0a4l-9612000000-5b6419b1f1bbee41ab89
Source of Spectrum Y1-42-1790-2
Wiley ID 1565261