ID: 19405
SMILES:C(CC)Cc1ccc(O)c(CC=C(CCC=C(C)C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.107
InChIKey:MIXCUUCNJULULK-UHFFFAOYSA-N
ID: 19406
SMILES:C1(C(=C)C)CC(OO)C(=C)CC1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.211
InChIKey:FAPGBEMFAKSHJV-UHFFFAOYSA-N
ID: 19407
SMILES:C(CCCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -18.24
InChIKey:ANCIVVONDMEABT-UHFFFAOYSA-N
ID: 19408
SMILES:c1(O)cc(C)cc2c1C(c1c(O)cc(CCCCC)cc1O)OC(C)(CCC=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -13.802
InChIKey:KPCZIPQLWHFRFP-UHFFFAOYSA-N
ID: 19409
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 19410
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C(C)C1OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.976
InChIKey:PGFFULLVBBCSMB-UHFFFAOYSA-N
ID: 19411
SMILES:CCCCCc1cc2c(c(O)c1)C1C3C(C)(CCC(C)(O)C3CCC1(C)O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 388.548
CB1 binding score: -17.477
InChIKey:XXRWDYLTGXMQES-UHFFFAOYSA-N
ID: 19412
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 19413
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C)(CC=C(C)C1)C(C)C2)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.632
CB1 binding score: Not available
InChIKey:NVFNPSJQDAXMQS-UHFFFAOYSA-N
ID: 19414
SMILES:C1(C(C)=C)C2c3c(O)c(O)c(C(C)(CCCCC)C)cc3OCC(C)=CCCC(C)=CCC2(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.76
CB1 binding score: -13.429
InChIKey:JGGVUUWUBCYVJJ-UHFFFAOYSA-N
ID: 19415
SMILES:C=C1C2c3c(c(CCCCC)cc(O)c3)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.416
InChIKey:UNRTZJFYXMIBDT-UHFFFAOYSA-N
ID: 19416
SMILES:O=C(C)OCC1=CC2c3c(cc(CCCCC)cc3O1)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.502
InChIKey:UMCCOZSGXFBBKI-UHFFFAOYSA-N
ID: 19417
SMILES:CC(=O)Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.103
InChIKey:VWMXULRJAFRZID-UHFFFAOYSA-N
ID: 19418
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 19419
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.723
InChIKey:WKFVIMFNRJVSJG-UHFFFAOYSA-N
ID: 19420
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 19421
SMILES:CC1(C)Oc2cc(C)c(O)cc2C2C1CC(C)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.887
InChIKey:NBMWKQYWHLWNGU-UHFFFAOYSA-N
ID: 19422
SMILES:c12c(c(CCCCC)cc(OC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.954
InChIKey:MRZCUYAPLPCXMS-UHFFFAOYSA-N
ID: 19423
SMILES:c12c(O)cc(C)cc1OC(C(CC)C)CC2CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -14.733
InChIKey:MJFBEDINBSGOMR-UHFFFAOYSA-N
ID: 19424
SMILES:C(CCC)Cc1c(O)cc(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.099
InChIKey:GLHHEMFRKBSLLH-UHFFFAOYSA-N
ID: 19425
SMILES:C1CC(C)=CCC1C(CCc1cc(OC)cc(O)c1)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -13.294
InChIKey:ITPNTYHGECUMPU-UHFFFAOYSA-N