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LRXYHMMJJCTUMY-UHFFFAOYSA-N

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LRXYHMMJJCTUMY-UHFFFAOYSA-N
SpectraBase Compound ID EWQc7yKsV6u
InChI InChI=1S/C27H33N3O7/c1-14(2)11-20-29-18-12-15(35-5)8-9-16(18)21-22(29)19(13-26(3,4)37-36-20)30-24(32)17-7-6-10-28(17)25(33)27(30,34)23(21)31/h8-9,11-12,17,19-20,23,31,34H,6-7,10,13H2,1-5H3
InChIKey LRXYHMMJJCTUMY-UHFFFAOYSA-N
Mol Weight 511.6 g/mol
Molecular Formula C27H33N3O7
Exact Mass 511.23185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3z7CcwcWDBc
Name 10,10a-Dihydroxy-7-methoxy-2,2-dimethyl-5-(2-methyl-1-propenyl)-1,10,10a,14,14a,15b-hexahydro-12H-3,4-dioxa-5a,11a,15a-triazacycloocta[lm]indeno[5,6-b]fluorene-11,15(2H,13H)-dione
Alternate Name(s) (5R-(5alpha,10 alpha,10aalpha,14aalpha,15balpha))-1,10,10a,14,14a,15b-hexahydro-10,10a-dihydroxy-7-methoxy-2,2-dimethyl-5-(2-methyl-1-propenyl)-5H,12H-3,4-dioxa-5a,11a,15a-triaza cyclooct (1m) indeno (5,6-b)fluorene-11,15(2H,13H)-dione 5H,12H-3,4-dioxa-5a,11a,15a-triazacyclooct(lm)indeno(5,6-b)fluorene-11,15(2H,13H)-dione, 1,10,10a,14,14a,15b-hexahydro-10,10a-dihydroxy-7-methoxy-2,2-dimethyl-5-(2-methyl-1-propenyl)-, (5R,10S,10aR,14aS,15bS)- 5H,12H-3,4-Dioxa-5a,11a,15a-triazacyclooct[lm]indeno[5,6-b]fluorene-11,15(2H,13H)-dione, 1,10,10a,14,14a,15b-hexahydro-10,10a-dihydroxy-7-methoxy-2,2-dimethyl-5-(2-methyl-1-propenyl)-, [5R-(5.alpha.,10.alpha.,10a.alpha.,14a.alpha.,15b.alpha.)]- TR1 Verruculogen Verruculogen tr 1
CAS Registry Number 12771-72-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H33N3O7
InChI InChI=1S/C27H33N3O7/c1-14(2)11-20-29-18-12-15(35-5)8-9-16(18)21-22(29)19(13-26(3,4)37-36-20)30-24(32)17-7-6-10-28(17)25(33)27(30,34)23(21)31/h8-9,11-12,17,19-20,23,31,34H,6-7,10,13H2,1-5H3
InChIKey LRXYHMMJJCTUMY-UHFFFAOYSA-N
Molecular Weight 511.575 g/mol
SMILES OC1C2(C(N3CCCC3C(N2C2c3[n](c4cc(ccc4c13)OC)C(OOC(C2)(C)C)C=C(C)C)=O)=O)O
SPLASH splash10-11bc-4691020000-9283aebdaf7366ddbfbd
Source of Spectrum W5-0-0-0
Wiley ID 1400648