ID: 41455
SMILES:Oc1c(C(=O)C(CC)C)c(O)c2c(c1)OC(C)(C)C1C2C(O)C(C)=CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.664
InChIKey:HOQSACVVUONBHC-UHFFFAOYSA-N
ID: 41456
SMILES:C(=O)C1=CC2C(CC1)C(C)(C)Oc1cc(CCc3ccccc3)cc(O)c12
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 362.469
CB1 binding score: -15.893
InChIKey:OSMLNEPJPZNLQH-UHFFFAOYSA-N
ID: 41457
SMILES:C1c2cc3c(cc2C2C(c4c(cc(CCCCC)cc4O)OC2(C)C)C(C)C1)OCC3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -14.472
InChIKey:PVHNHNOENLVHCR-UHFFFAOYSA-N
ID: 41458
SMILES:C12(CO)C3C(C(C)(CO)C3)CCC1(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -12.737
InChIKey:IYSNCONGHCONJJ-UHFFFAOYSA-N
ID: 41459
SMILES:c1(CCCCCC)cc2c3c(c1)OC1(C)CC3C(C(C)C)CC1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -15.56
InChIKey:AGUQMCGGMRPFHS-UHFFFAOYSA-N
ID: 41460
SMILES:C1=C(C)C(O)CC=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -18.653
InChIKey:PZVRSZDWBHVXLP-UHFFFAOYSA-N
ID: 41461
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 41462
SMILES:C1CC2C3(C)Oc4cc(CCCCC)cc(O)c4C2CC(C)(C1=O)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.051
InChIKey:KSYCYTMRIIBNEX-UHFFFAOYSA-N
ID: 41463
SMILES:C(=C)C1(C)CC(O)C2=C3C(OC)(CCC21)C1c2c(cc(CCCCC)cc2O)OC(C)(C)C1CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -16.015
InChIKey:KWGZFEYFLGHRRD-UHFFFAOYSA-N
ID: 41464
SMILES:c1(C(C2=C(O)C3=C(C(C)(C)C(=O)C(C)(C)C3=O)C(C)C2)C)ccc2c(c1)OC(C)(C)C1C2C=C(CCC=C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 570.814
CB1 binding score: -16.01
InChIKey:CTIKNSJJJUVHHG-UHFFFAOYSA-N
ID: 41465
SMILES:c1(O)c2c(cc(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.766
InChIKey:GNBSKWGIRCMMKP-UHFFFAOYSA-N
ID: 41466
SMILES:C1(O)CC2=Cc3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -18.913
InChIKey:GLNNZSULGAVNIZ-UHFFFAOYSA-N
ID: 41467
SMILES:C(=C)C1(CC2c3c(cccc3C)Oc3c2c(O)cc(CCCCC)c3)OC(C)(C)C(OC(=O)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.656
CB1 binding score: -13.519
InChIKey:ULGXPTKZDYLLEB-UHFFFAOYSA-N
ID: 41468
SMILES:C12=C(C)C=CC13C(C)CCC3C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 204.313
CB1 binding score: -16.36
InChIKey:QHPFAIFYXYRWML-UHFFFAOYSA-N
ID: 41469
SMILES:C=C(C1CCC(C)=CC1c1c(O)ccc(CCCCC)c1)C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -11.891
InChIKey:XNKVNRMRWZNSAY-UHFFFAOYSA-N
ID: 41470
SMILES:OC(C)(C1CC(=O)C(C)=CC1c1c(OC(C)=O)cc(CCCCCC)cc1OC(=O)C)C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -15.929
InChIKey:GOPJTJKWBCRLGR-UHFFFAOYSA-N
ID: 41471
SMILES:C1C(C)C2C(O)(c3c(cc(CCCCC)cc3O)OC2)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -18.346
InChIKey:BHJKUBYYBYSUQC-UHFFFAOYSA-N
ID: 41472
SMILES:C1(C)(C)C2C(c3c(cc(CCCCCO)cc3O)O1)C1OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.139
InChIKey:QLRZPWSFOWIKMX-UHFFFAOYSA-N
ID: 41473
SMILES:C(C)(CO)CCCC1=CC(c2c(O)ccc(O)c2)C(C(=C)CO)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.955
InChIKey:YKHQEZBSKGIUQK-UHFFFAOYSA-N
ID: 41474
SMILES:c12c(c(O)cc(CCCC)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 41475
SMILES:C(CC)CCCc1cc2c(c(O)c1)C1C(C(C)C)(CC2C2(C)CCC(C(OC)(C)C)O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.656
CB1 binding score: -15.032
InChIKey:SQRCSGNMMJBAIC-UHFFFAOYSA-N