ID: 125497
SMILES:CC1COc2cc(CCCCC)c(O)c(C(=O)OC(C)(C)CC)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.638
InChIKey:PMGVNLXXFNOPDL-UHFFFAOYSA-N
ID: 125498
SMILES:O(c1c(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.273
InChIKey:QQKRWAQYJVGZFH-UHFFFAOYSA-N
ID: 125499
SMILES:C(=C)C1c2c(c(C)c(=O)c(O)cc2CCCCC)CC(CCC=C(C)CO)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -9.716
InChIKey:ZHGKBCAVUAGXHE-UHFFFAOYSA-N
ID: 125500
SMILES:C=CCc1cc(O)c2c(c1)OC(C)(C)C1C(O)CC(CO)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.986
InChIKey:LXSGROCINCFDQN-UHFFFAOYSA-N
ID: 125501
SMILES:CC1(C)CCC(OC)C1(C)C1CC(=O)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.714
InChIKey:LHSBCMFRGDGQFE-UHFFFAOYSA-N
ID: 125502
SMILES:O1C(C)(C)C2CCC(C)C3C2(c2c(O)c(C4C=C(C)CCC4C(C)(O)C)c(O)cc2C)OC13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -12.207
InChIKey:BLSXHQJAHCATNW-UHFFFAOYSA-N
ID: 125503
SMILES:C12=CCCC(C(O)=O)C13C(c1c(cc(CCCCC)cc1O)OC3(C)C)C=C(C(C)C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -15.288
InChIKey:XOIRHNNIYWZPNO-UHFFFAOYSA-N
ID: 125504
SMILES:C(c1c2c(cc(O)c1)C(=O)OC(C)(C)C1CCC(C)=CC21)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -14.658
InChIKey:QSCDBOVGPVUESO-UHFFFAOYSA-N
ID: 125505
SMILES:C(CC)CCc1cc(OC(=O)C)c(C2C(C(C)=C)CC=C(C)C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.78
InChIKey:ZIMGSXZIRNPFSE-UHFFFAOYSA-N
ID: 125506
SMILES:CC1(C)Oc2cc(C)cc(O)c2C(O)C2C1CCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.227
InChIKey:GOUWEMPCQYCBEQ-UHFFFAOYSA-N
ID: 125507
SMILES:c1(O)c(OC2(C(C)C)CC=C(C)CC2)cc(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.706
CB1 binding score: -14.471
InChIKey:FCARIAZSIUWYHG-UHFFFAOYSA-N
ID: 125508
SMILES:Oc1cc(CCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 125509
SMILES:C(C)(=CCC1C(C)(C2CCC(CO)=CC2c2c(O)cc(CCCCC)cc2O)CO1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -12.803
InChIKey:CWIJFSXSJMWBMI-UHFFFAOYSA-N
ID: 125510
SMILES:C1(=C)CCC(C(C)=CO)C1c1c(O)cc(CCCCO)c(C(O)=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.422
CB1 binding score: -11.804
InChIKey:LLGFCUFHMOGCNJ-UHFFFAOYSA-N
ID: 125511
SMILES:c1(C)cc(OC)c(C2C(C(C)=C)CCC(C)=C2)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -16.909
InChIKey:RHRJVNCYKXDSJN-UHFFFAOYSA-N
ID: 125512
SMILES:c1(O)cc(CCCCC)cc2c1C1CC(C)(C)OC(C)(C)C13CCC(C)C3(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -13.363
InChIKey:SCRNQFPWNBECQN-UHFFFAOYSA-N
ID: 125513
SMILES:C(C)c1c(C=CC(O)C)cc(O)c(C2C=C(C)CCC2C(C)=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.67
InChIKey:ZXFRUPWLGABQCZ-UHFFFAOYSA-N
ID: 125514
SMILES:C(=CCCC(=CCc1c(O)cc(CCC)cc1OC(C)(C)C)C)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -11.768
InChIKey:KBLIJZIXFZDMGL-UHFFFAOYSA-N
ID: 125515
SMILES:C(C)CCCc1cc(O)c2c(c1C(C(CC)C)=O)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.498
InChIKey:GCRVTEHRJIGKKO-UHFFFAOYSA-N
ID: 125516
SMILES:C1CC2C(C(=O)NCCCC(=O)O)(c3c(O)cc(CCCCC)cc3O2)CC1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 447.572
CB1 binding score: -15.929
InChIKey:DTRBLRDNBOUCER-UHFFFAOYSA-N
ID: 125517
SMILES:C1(C)=CC2c3c(ccc(CCCCC)c3)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -19.248
InChIKey:ULSCPFQNHAPIEH-UHFFFAOYSA-N