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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

pilocereine  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C45H65N3O6

inchi

  • InChI=1S/C45H65N3O6/c1-26(2)19-33-32-25-37(36(50-10)22-29(32)13-16-46(33)7)53-45-41-31(15-18-48(9)35(41)21-28(5)6)24-39(52-12)43(45)54-44-40-30(23-38(51-11)42(44)49)14-17-47(8)34(40)20-27(3)4/h22-28,33-35,49H,13-21H2,1-12H3

inchikey

  • AFQDIEHIPKSXRL-UHFFFAOYSA-N

mass

  • 744.016

monoisotopicmass

  • 743.48734

smiles

  • COc1cc2CCN(C)C(CC(C)C)c2cc1Oc1c(Oc2c(O)c(OC)cc3CCN(C)C(CC(C)C)c23)c(OC)cc2CCN(C)C(CC(C)C)c12

subset

  • 2_STAR

synonym EXACT

  • Pilocereine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:8208

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