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Heterocyclic building blocks

Pseudostellarin D

Also known as Cyclo(gly-pro-leu-ile-leu-gly-tyr)

CAS 158335-65-0Formula C36H55N7O8Molar mass 713.88 g/mol
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Pseudostellarin D chemical structure, C36H55N7O8, CAS 158335-65-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
158335-65-0
Formula
C36H55N7O8
Molar mass
713.88 g/mol
HS code
293379
Category
Heterocyclic building blocks

What is Pseudostellarin D?

Plain description, key identifiers and synonyms

Pseudostellarin D has been reported in Pseudostellaria heterophylla.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(6S,12S,18S,21S)-15-[(2S)-butan-2-yl]-6-[(4-hydroxyphenyl)methyl]-12,18-bis(2-methylpropyl)-1,4,7,10,13,16,19-heptazabicyclo[19.3.0]tetracosane-2,5,8,11,14,17,20-heptone
CAS number
158335-65-0 CAS number cross-checked
Molecular formula
C36H55N7O8
InChIKey
AEYSUFUZZXZLEV-KBPCQMSISA-N
InChI
InChI=1S/C36H55N7O8/c1-7-22(6)31-36(51)41-25(15-20(2)3)32(47)37-18-29(45)39-27(17-23-10-12-24(44)13-11-23)33(48)38-19-30(46)43-14-8-9-28(43)35(50)40-26(16-21(4)5)34(49)42-31/h10-13,20-22,25-28,31,44H,7-9,14-19H2,1-6H3,(H,37,47)(H,38,48)(H,39,45)(H,40,50)(H,41,51)(H,42,49)/t22-,25-,26-,27-,28-,31?/m0/s1
Canonical SMILES
CCC(C)C1NC(=O)C(CC(C)C)NC(=O)C2CCCN2C(=O)CNC(=O)C(Cc2ccc(O)cc2)NC(=O)CNC(=O)C(CC(C)C)NC1=O
Isomeric SMILES
CC[C@H](C)C1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N1)CC(C)C)CC3=CC=C(C=C3)O)CC(C)C

Synonyms

  • Cyclo(gly-pro-leu-ile-leu-gly-tyr)

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
713.88 g/molcalc.
Exact mass
713.4112 Dacalc.
LogP (octanol/water)
0.25calc.
Topological polar surface area
215.1 Ųcalc.
Hydrogen bond donors
7calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
8calc.
Heavy atoms
51calc.
Rings
3calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.64calc.
Formal charge
0calc.
Stereocentres
6calc.
Lipinski rule of five
Fails (2 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C1CNC(=O)CNC(=O)C2CCCN2C(=O)CNC(=O)C(Cc2ccccc2)NC(=O)CNC(=O)CN1

O=C1CNC(=O)CNC(=O)C2CCCN2C(=O)CNC(=O)C(Cc2ccccc2)NC(=O)CNC(=O)CN1

3 rings, 38 atoms.

1 other chemical share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Pseudostellarin D suppliers

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Pseudostellarin D price

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Pseudostellarin D is traded under.

HS 2933.79Indicative HS code

Lactams, other lactams

World exports in 2024
$16.2B
−64.4% vs 2023, imports $15.4B
2019 to 2024
Top exporters
  1. Ireland37.0%
  2. France * partner reported15.6%
  3. Spain11.3%
Top importers
  1. Germany27.8%
  2. Ireland18.9%
  3. Panama * partner reported12.9%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Pseudostellarin D is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Pseudostellarin D, based on the data on this page

What is Pseudostellarin D?

Pseudostellarin D has been reported in Pseudostellaria heterophylla.

What is the CAS number of Pseudostellarin D?

The CAS registry number of Pseudostellarin D is 158335-65-0.

What is the molecular formula and weight of Pseudostellarin D?

The molecular formula of Pseudostellarin D is C36H55N7O8 and its molar mass is 713.88 g/mol.

What is Pseudostellarin D used for?

Known uses and roles of Pseudostellarin D include building blocks in research and laboratory.

Is Pseudostellarin D hazardous?

No GHS hazard classification for Pseudostellarin D is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Pseudostellarin D?

Pseudostellarin D is usually classified under HS code 293379 (Lactams, other lactams). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Pseudostellarin D?

Post a free request on CompoundList and suppliers of Pseudostellarin D will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Pseudostellarin D?

Suppliers quote Pseudostellarin D on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Pseudostellarin D

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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