ID: 101515
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 101516
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C(C(O)C(O)(C)CC2)C1=O)(C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -12.69
InChIKey:YXJLIHNPGJNFRS-UHFFFAOYSA-N
ID: 101517
SMILES:C(C=CC(C(=CC)C)=O)(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -17.49
InChIKey:VZJXWBDXHAIWJN-UHFFFAOYSA-N
ID: 101518
SMILES:c1(C=O)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -18.186
InChIKey:IMOLNLFPZZCPDW-UHFFFAOYSA-N
ID: 101519
SMILES:C1(CCC=C(C)C)(C)Oc2cc(CCC)cc(O)c2C(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.427
InChIKey:UICJWNGMMYLYIP-UHFFFAOYSA-N
ID: 101520
SMILES:C(C)(OC)(c1c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -13.148
InChIKey:QHCHUYUNCKZGGR-UHFFFAOYSA-N
ID: 101521
SMILES:c1(OC)cc(CC2CCC(C(=C)C)C2CC=O)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.556
InChIKey:FXOBOZIHDHRUFM-UHFFFAOYSA-N
ID: 101522
SMILES:c1(O)c2c(ccc1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.926
InChIKey:PHOCHXXTKASADH-UHFFFAOYSA-N
ID: 101523
SMILES:C(CC(C)=CCc1c(O)cc(CCCCCOC(C)=O)cc1O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.6
InChIKey:FYUVIMXYCOYDHB-UHFFFAOYSA-N
ID: 101524
SMILES:C(C12C(CCC(C)C13Oc1c(c(O)cc(CCCCC)c1)C3)O2)(C(C)=C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -13.781
InChIKey:FYDFPSPVGCNBIY-UHFFFAOYSA-N
ID: 101525
SMILES:O1c2c(c(O)cc(CCCC)c2)C2C3(C)C(C1C(=C)C)C(OC)(OC3OC)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -13.904
InChIKey:MFMLEPYLOACXHU-UHFFFAOYSA-N
ID: 101526
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 101527
SMILES:C1(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C(OC(=O)C=C(C)C)C1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -12.825
InChIKey:QHTBYILZBUUVAH-UHFFFAOYSA-N
ID: 101528
SMILES:C(CC)CCc1cc(OC)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.823
InChIKey:GRLARWXSTOXAGR-UHFFFAOYSA-N
ID: 101529
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 101530
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2OC)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -21.398
InChIKey:WPVARKYNWHKQMW-UHFFFAOYSA-N
ID: 101531
SMILES:O1c2c(cccc2)C2C3C(=O)C1(C)CC(CC=C(C)C)C(C)(CCC=C(C)C)Oc1c-3cc(O)cc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Polyprenylated cyclic polyketides (Hop meroterpenoids)
MW: 544.732
CB1 binding score: -12.327
InChIKey:OBHZZWGANDQZIJ-UHFFFAOYSA-N
ID: 101532
SMILES:O1c2cc(C)cc(O)c2C(CC(C)(CBr)O)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 329.234
CB1 binding score: -13.798
InChIKey:CUEZVRPNEVRESI-UHFFFAOYSA-N
ID: 101533
SMILES:C(C=C(C)CCC=C(C)C)Oc1c(O)cc(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.108
InChIKey:HUOSBKDCWCFSDM-UHFFFAOYSA-N
ID: 101534
SMILES:Cc1c(C)c(Cc2cc(O)c(OC)c(C=O)c2)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.549
CB1 binding score: -15.374
InChIKey:UDXRUEJEUQEMMI-UHFFFAOYSA-N
ID: 101535
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N