Dihydroergocristine

CAS: 17479-19-5

Ref. 04-C12634545

Product Information

• Name: Dihydroergocristine
• Synonyms: Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)-, (5'a,10a)-, Ergocristine, 9,10-dihydro- (8CI), Ergocristine, dihydro- (7CI), (5'a,10a)-9,10-Dihydro-12'-hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)ergotaman-3',6',18-trione, 8H-Oxazolo[3,2-a]pyrrolo[2,1-c]pyrazine, ergotaman-3',6',18-trione deriv., Indolo[4,3-fg]quinoline, ergotaman-3',6',18-trione deriv., 9,10-Dihydroergocristine, Dihydroergocristin, NSC 409663, (5'A,10A)-5'-Benzyl-12'-Hydroxy-3',6',18-Trioxo-2'-(Propan-2-Yl)-9,10-Dihydroergotaman, (5'Alpha,10Alpha)-5'-Benzyl-12'-Hydroxy-3',6',18-Trioxo-2'-(Propan-2-Yl)-9,10-Dihydroergotaman, (5'a,10a)-9,10-Dihydro-12'-hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)erotaman-3',6',18-trione, (5'alpha,10alpha)-5'-Benzyl-12'-hydroxy-2'-isopropyl-3',6',18-trioxo-9,10-dihydroergotaman, (5′α,10α)-9,10-Dihydro-12′-hydroxy-2′-(1-methylethyl)-5′-(phenylmethyl)ergotaman-3′,6′,18-trione, 17479-19-5, 8H-Oxazolo[3,2-a]pyrrolo[2,1-c]pyrazine, ergotaman-3′,6′,18-trione deriv., Ergocristine, 9,10-dihydro-, Ergocristine, dihydro-, Ergotaman, 9,10-Dihydro-12'-Hydroxy-2'-(1-Methylethyl)-3',6',18-Trioxo-5'-(Phenylmethyl)-, (5'Alpha,10Alpha)-, Ergotaman-3′,6′,18-trione, 9,10-dihydro-12′-hydroxy-2′-(1-methylethyl)-5′-(phenylmethyl)-, (5′α,10α)-, Indolo[4,3-fg]quinoline, ergotaman-3′,6′,18-trione deriv.
• CAS: 17479-19-5
• Brand: Doctor Ehrenstorfer

Chemical properties

• Molecular weight: 611.73
• Formula: C₃₅H₄₁N₅O₅
• Color/Form: Neat
• InChI: InChI=1S/C35H41N5O5/c1-20(2)34(37-31(41)23-16-25-24-11-7-12-26-30(24)22(18-36-26)17-27(25)38(3)19-23)33(43)40-28(15-21-9-5-4-6-10-21)32(42)39-14-8-13-29(39)35(40,44)45-34/h4-7,9-12,18,20,23,25,27-29,36,44H,8,13-17,19H2,1-3H3,(H,37,41)/t23-,25-,27-,28+,29+,34-,35+/m1/s1
• InChI key: InChIKey=DEQITUUQPICUMR-HJPBWRTMSA-N
• SMILES: CC(C)[C@@]1(NC(=O)[C@@H]2C[C@@H]3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)O[C@@]2(O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O