ID: 99562
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 99563
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 99564
SMILES:C(CCc1cc(OC)c(C2C(C(=C)C)CC(=O)C(C)=C2)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.917
InChIKey:VYGFAQULXCDHPB-UHFFFAOYSA-N
ID: 99565
SMILES:C(Cc1cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1)CC(=O)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.893
InChIKey:GKCZDUHDXVOFOF-UHFFFAOYSA-N
ID: 99566
SMILES:C(c1cc(O)c(CC=C(C)CC(O)C=C(C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -17.521
InChIKey:UVCSQRGSZKGGRB-UHFFFAOYSA-N
ID: 99567
SMILES:O=CCc1cc2c(c(OC)c1)C=CC(CCC=C(C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.906
InChIKey:DTPNNXOGTFQTKL-UHFFFAOYSA-N
ID: 99568
SMILES:CC(CCC=C(CCC=C(CCC=C(C)C)C)C)Cc1c(O)cc(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.712
CB1 binding score: -16.446
InChIKey:HOWRWDMERXJFJG-UHFFFAOYSA-N
ID: 99569
SMILES:C1(C)CC(=O)C(=C(C)C)C=C1CCCC(CCCc1ccccc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.535
CB1 binding score: -14.716
InChIKey:WNPWWDXSZRQJIL-UHFFFAOYSA-N
ID: 99570
SMILES:C1(=O)C(O)=C2C(C)(c3c1cc(CCCCC)cc3OC(C)=O)C(=O)CCC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -14.921
InChIKey:XVAZZLOMPXBZKS-UHFFFAOYSA-N
ID: 99571
SMILES:OCC1(C)C2C3C(C)(C)C2C(c2c(cc(C)cc2O)O1)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.822
InChIKey:OMIKBOYGCFVYCK-UHFFFAOYSA-N
ID: 99572
SMILES:CCOc1cc(OC)c(OC)c2c1C1C=C(C=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -12.748
InChIKey:WIYVOTAGQRDOBL-UHFFFAOYSA-N
ID: 99573
SMILES:C(CCC=CCc1cc(O)c2c(c1C)OC(C)(C)C1C2C=C(CO)CC1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 396.571
CB1 binding score: -15.166
InChIKey:UOEXYKBBUTWFCE-UHFFFAOYSA-N
ID: 99574
SMILES:C(c1cc(O)c(CC=C(C)CCC=C(C)C)c(OC)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.187
InChIKey:ZKXZJUZIDUHJLH-UHFFFAOYSA-N
ID: 99575
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CC=C(C)C1=O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 99576
SMILES:C(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)(C)CCC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 99577
SMILES:c1(O)cc(CCCC)cc2c1C1C(O)C(C)(O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -17.628
InChIKey:FZPZZJPSHOYKIF-UHFFFAOYSA-N
ID: 99578
SMILES:C(c1cc2c(c(O)c1)-c1c(O)cc(CCCCC)cc1OC2(C)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -15.451
InChIKey:OVHOLDPDXSQBIE-UHFFFAOYSA-N
ID: 99579
SMILES:C1CCC2(C(=O)OC)C(C=O)=CCCC2C1(Cc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -15.411
InChIKey:QNWPBDAIGFMIOG-UHFFFAOYSA-N
ID: 99580
SMILES:C1(C)(C)C2C(c3c(cc(CCCCC)cc3O)O1)C(=O)C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 99581
SMILES:O(C(C)=O)C1C(C(C)C)C2C3(Oc4c(C=O)c(CCCCC)cc(O)c43)C3C(C(O)(CO2)C1)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.578
CB1 binding score: -16.365
InChIKey:FFQPENOSIGIBNZ-UHFFFAOYSA-N
ID: 99582
SMILES:CC1(C)Oc2c(c(O)cc(CC=C)c2)C2C1CCC(=C)C2CCC(C)=CCO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.217
InChIKey:UQMOMBNJOALHOB-UHFFFAOYSA-N