ID: 96244
SMILES:C(Cl)C1(C)Oc2c(c(O)c(Cl)c(C)c2)-c2cc(O)cc(CCCCC)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 395.326
CB1 binding score: -12.493
InChIKey:HTYIQWMHYNHBJF-UHFFFAOYSA-N
ID: 96245
SMILES:C(C)Cc1cc(O)c2c(c1)OC1(C)C3OC(C)(CCC1C(C)(C)O2)CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.714
InChIKey:HVPNJKWGDLJRIM-UHFFFAOYSA-N
ID: 96246
SMILES:c1(CCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 96247
SMILES:C(CC)CCc1cc2c(cc1O)OC1(C)CC2C(=C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.605
InChIKey:YWCFIOXTLCJERT-UHFFFAOYSA-N
ID: 96248
SMILES:C(CCCC)Cc1cc(O)c2cc1C(=O)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -14.263
InChIKey:RQVSJYWBNMNNFF-UHFFFAOYSA-N
ID: 96249
SMILES:C(C1=C(C)C(=O)CC1C1(C)CCC(OC(=O)C)C(C)(C)O1)CCCC(OC(C)=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.562
CB1 binding score: -14.591
InChIKey:HNUOTBTWJCBVTJ-UHFFFAOYSA-N
ID: 96250
SMILES:CC1(CCOC(C=C(C)C)=O)C2(C)C(CC=C1C)c1c(OC)cc(CCC(=O)CC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -14.403
InChIKey:WTSUPXIDUVGTFJ-UHFFFAOYSA-N
ID: 96251
SMILES:c12c(cc(CCCCC)cc1O)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: 96252
SMILES:C(CC(C)CC(=O)c1c(O)c(C=O)c(O)c2c1OC(C)(C)C1CCC(C)=CC12)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 414.542
CB1 binding score: -15.817
InChIKey:WZGYXGPKBPSQGT-UHFFFAOYSA-N
ID: 96253
SMILES:c1(C)ccc2c(c1)C1(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.502
CB1 binding score: -15.434
InChIKey:IGTCIXBCNXHQCY-UHFFFAOYSA-N
ID: 96254
SMILES:Cc1cc(O)cc(CC=C(C)CCC(OC(C)=O)C(=C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.815
InChIKey:KQEPEOVZIAHBHQ-UHFFFAOYSA-N
ID: 96255
SMILES:C(C)(CCCc1cc2c(c(O)c1)C1C(CC=C(C)C1CC=C(C)C)C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.883
InChIKey:XQCQMPHZCJRBGX-UHFFFAOYSA-N
ID: 96256
SMILES:C(=C(C)C)CCC(C)CC1Oc2c(c(O)cc(CCCCC)c2)C(=O)C(C)=C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -13.432
InChIKey:AQNUSANGOBZABE-UHFFFAOYSA-N
ID: 96257
SMILES:C12C(O)(c3c4c5c(c(O)c31)NCC(C)(O5)CC=C(CCC=C(C)C)C4)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 441.568
CB1 binding score: -14.375
InChIKey:XUNUALZZZQBCSR-UHFFFAOYSA-N
ID: 96258
SMILES:CC(C)=C1C2OC(=O)C3(OC23)C2C(O)c3c(O)cc(C(C)C(C(CCCCC)C)C)cc3OC2(C)OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.659
CB1 binding score: -12.583
InChIKey:UFWBZSQHTCWNJW-UHFFFAOYSA-N
ID: 96259
SMILES:CC12CC3c4c(O)cc(CCCCC)cc4OC1(C3O)C(C)CCC2C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -13.388
InChIKey:INSONTQRDKCOSN-UHFFFAOYSA-N
ID: 96260
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C3CCC(C)C13CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -13.096
InChIKey:IZUYRXWEIJRQJY-UHFFFAOYSA-N
ID: 96261
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 96262
SMILES:C(CCCc1cc2c(c(O)c1)C1C3(O2)C(C)(CCC(=O)O1)OC3)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -16.943
InChIKey:ZNHMHKWJHDTSEA-UHFFFAOYSA-N
ID: 96263
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 96264
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.604
InChIKey:AUPXTHSHVYGTBU-UHFFFAOYSA-N