ID: 41371
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(OC)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 41372
SMILES:c1c(O)c2c(c(C=O)c1CCC=CC)OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -15.374
InChIKey:FIFKQGBALRQHOD-UHFFFAOYSA-N
ID: 41373
SMILES:C(CCC(C)=CCC12C(C(C)C(c3cc(O)cc(C)c3)=CC1O)O2)C=CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -14.793
InChIKey:FWXWPWYWWIVAFA-UHFFFAOYSA-N
ID: 41374
SMILES:C(CCCc1cc(O)c2c(c1)C(C)(C)Oc1cccc(C)c12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -16.15
InChIKey:GGEPJGPVUBCNKU-UHFFFAOYSA-N
ID: 41375
SMILES:C1(CC(C)=CCc2c(O)c(C)cc(OC)c2)=CC(C)(C)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.1
InChIKey:OKDFAPXXWCIWMG-UHFFFAOYSA-N
ID: 41376
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2-c2c(O)cc(CCCCC)cc2O)C2C(C(C)C)CCC(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.743
CB1 binding score: -14.605
InChIKey:MCVMVNLYDVPNTE-UHFFFAOYSA-N
ID: 41377
SMILES:CCCCCc1cc2c(c(O)c1C(=O)OCCC(C)C)C(C)CC(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -14.94
InChIKey:JYADINDUIARNFG-UHFFFAOYSA-N
ID: 41378
SMILES:Oc1c(CC=C(C)C)c(O)c(C=O)c(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.049
InChIKey:UTQODHOHWHAWHC-UHFFFAOYSA-N
ID: 41379
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C=C2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.492
CB1 binding score: -16.502
InChIKey:FJFCDAFFKIGANF-UHFFFAOYSA-N
ID: 41380
SMILES:c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C(=O)O)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -17.348
InChIKey:GEHHJQGAIKWVCS-UHFFFAOYSA-N
ID: 41381
SMILES:O=C(C)CCC1C(C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -18.167
InChIKey:QSOGTOVBOHNCQA-UHFFFAOYSA-N
ID: 41382
SMILES:C(CCC)CCc1cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.422
InChIKey:LABMCTIAZNCACZ-UHFFFAOYSA-N
ID: 41383
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(COC2OC(CO)C(O)C(O)C2O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.609
CB1 binding score: -16.775
InChIKey:XLAKLUKOUJQOFH-UHFFFAOYSA-N
ID: 41384
SMILES:C(CCCC)c1cc2c(c(O)c1)C1=CC(C)(O)CCC1C(C)(O2)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -18.374
InChIKey:YHSSGGORTWXHQC-UHFFFAOYSA-N
ID: 41385
SMILES:O(C(=O)C(C)C)CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.373
InChIKey:SNBUUYQSOJIASY-UHFFFAOYSA-N
ID: 41386
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 41387
SMILES:O=c1c(O)c(CCCC)cc2c(c1O)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.506
InChIKey:BSRQRLFSRDEIGH-UHFFFAOYSA-N
ID: 41388
SMILES:CC(=CCCC1(C)Oc2cc(CCC)cc(O)c2CC1)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -13.848
InChIKey:LTODYXVKNUPGFP-UHFFFAOYSA-N
ID: 41389
SMILES:C1(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 41390
SMILES:C1=C(C)C(Cc2c(=O)oc(C)c(C)c2O)CC(C(C)=C)C1c1cc(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -16.917
InChIKey:QOALZLHWDGRQJC-UHFFFAOYSA-N
ID: 41391
SMILES:CC12Oc3c(c(O)cc(CCCCC)c3)CC1C(=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.762
InChIKey:LIRHHPNTSZNRFO-UHFFFAOYSA-N