3-Deoxyaconitine

Catalog Number	ACM3175959-1
CAS Number	3175-95-9
Structure
Synonyms	Deoxyaconitine
Molecular Weight	629.7
InChI	InChI=1S/C34H47NO10/c1-7-35-16-31(17-40-3)14-13-21(41-4)33-20-15-32(39)28(44-30(38)19-11-9-8-10-12-19)22(20)34(45-18(2)36,27(37)29(32)43-6)23(26(33)35)24(42-5)25(31)33/h8-12,20-29,37,39H,7,13-17H2,1-6H3/t20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1
InChI Key	PHASMOUKYDUAOZ-IXLJIIPOSA-N
Melting Point	177-180 °C
Purity	95%+
Complexity	1180
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	13
Exact Mass	629.3199967
Heavy Atom Count	45
Hydrogen Bond Acceptor Count	11
Hydrogen Bond Donor Count	2
Isomeric SMILES	CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@H]([C@@H](C31)[C@@]5([C@@H]6[C@H]4C[C@@]([C@@H]6OC(=O)C7=CC=CC=C7)([C@H]([C@@H]5O)OC)O)OC(=O)C)OC)OC)COC
Monoisotopic Mass	629.3199967
PhysicalState	Powder
Rotatable Bond Count	11
Topological Polar Surface Area	133 Ų

Custom Q&A

What is the chemical formula for 3-DEOXYACONITINE?

The chemical formula for 3-DEOXYACONITINE is C34H47NO10.

How much does 3-DEOXYACONITINE weigh?

3-DEOXYACONITINE weighs 629.74 grams per mol.

Can you please provide the molecular formula for 3-DEOXYACONITINE?

The molecular formula for 3-DEOXYACONITINE is C34H47NO10.

What are some synonyms for 3-DEOXYACONITINE?

Some synonyms for 3-DEOXYACONITINE are 3-DEOXYACONITINE.

What is the molecular weight of 3-DEOXYACONITINE?

The molecular weight of 3-DEOXYACONITINE is 629.74 g/mol.

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