ID: 87424
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 87425
SMILES:Oc1c2c(cc(CCCCC)c1C(OC)=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -18.882
InChIKey:PZGQMCZVNQZFFP-UHFFFAOYSA-N
ID: 87426
SMILES:C(CCC)Cc1cc2c(c(O)c1)OC(C)(CCC=C(CCC=C(C)C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -17.071
InChIKey:KOIWJUXASCTNFR-UHFFFAOYSA-N
ID: 87427
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -17.439
InChIKey:XVOPFYNMQOZUKH-UHFFFAOYSA-N
ID: 87428
SMILES:CC(=CCc1c(O)cc(CC2C(C(=C)C)CCC(C)=C2)c(O)c1)CCC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.718
CB1 binding score: -16.409
InChIKey:CJOWGMYSBMRISL-UHFFFAOYSA-N
ID: 87429
SMILES:CC1C2(O)C(c3c(O)cc(CCCCC)cc3O1)C(C)CCC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.039
InChIKey:QVEKFCZTZJXQGH-UHFFFAOYSA-N
ID: 87430
SMILES:c1(CCCC)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -20.03
InChIKey:LXMICYYYVWWGAM-UHFFFAOYSA-N
ID: 87431
SMILES:CC(=CCC12CC(C(c3c(O)c(C(=O)O)c(CCCCC)cc3O)C(=O)O1)CC=C(C)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -10.893
InChIKey:PMDAQKTYMYPKGJ-UHFFFAOYSA-N
ID: 87432
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C3C(CC1(C)O2)C(O)(C)CCC3C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 402.575
CB1 binding score: -15.929
InChIKey:LRRYQPABFVVSHQ-UHFFFAOYSA-N
ID: 87433
SMILES:CC1(C)Oc2cc(CCCCC)c(C3C=C(C)CCC3C(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.929
InChIKey:CGTVZQUFAAHZHC-UHFFFAOYSA-N
ID: 87434
SMILES:O(c1cc(CCc2ccccc2)cc2c1-c1c(ccc(C)c1)C(C)(C)O2)C(=O)CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.572
CB1 binding score: -15.481
InChIKey:ZLBAQKHQYMQDGA-UHFFFAOYSA-N
ID: 87435
SMILES:c1(CC2C(=C)CC(C)(C)CC2)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -15.323
InChIKey:PXSGPWZBEUZLIN-UHFFFAOYSA-N
ID: 87436
SMILES:COc1c(O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -17.033
InChIKey:MOIBWKZZIIDVBX-UHFFFAOYSA-N
ID: 87437
SMILES:C(CC(=O)O)c1cc(O)c2c(c1)OC(C)(C)C1C(=C(C)CC2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -11.857
InChIKey:QVRLBSAVVUNTOS-UHFFFAOYSA-N
ID: 87438
SMILES:C(CC=C(C)C)C(=CCc1c(O)c2c(c(C(=O)CC(C)C)c1O)OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -15.824
InChIKey:OISVEASZUYNWCK-UHFFFAOYSA-N
ID: 87439
SMILES:CC(CC(c1c(O)c2c(cc1OC)OC(C)(C)C1CCC(C)=CC12)C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.179
InChIKey:KPDBBTCMCFMURR-UHFFFAOYSA-N
ID: 87440
SMILES:C(CCCc1cc(O)c2c(c1O)C1C(CCC(C)=C1)C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.74
InChIKey:KWFCGPRHQHJJMW-UHFFFAOYSA-N
ID: 87441
SMILES:c1(O)c2c(cc(CCCCC)c1C(=O)OC)OC(C)(C)C(O)CCC(=CCCC(C)(OC(=O)C)C=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.675
CB1 binding score: -13.979
InChIKey:LGDKUIBNAGPPGF-UHFFFAOYSA-N
ID: 87442
SMILES:C(Cc1c(CCCC)c(OC)c2c(c1O)OC(C)(C)C1CC(=O)C(C)C1C2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.929
InChIKey:YMBBPDHLMWITRH-UHFFFAOYSA-N
ID: 87443
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(OO)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.439
InChIKey:CKCDWNPGSJYYHP-UHFFFAOYSA-N
ID: 87444
SMILES:C1C(=O)C2(Cc3c(O)c(C(=O)O)c(CCCCC)cc3O2)C2(C)CCCC(C)(C)C2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -15.704
InChIKey:IHGDYFWUGVVKLN-UHFFFAOYSA-N