ID: 85618
SMILES:C(CCc1cc(O)c2c(c1O)OC(CCC1=C(C)CC(O)CC1(C)C)(C)CC2=O)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -15.304
InChIKey:VDFCZYUWAVGYAQ-UHFFFAOYSA-N
ID: 85619
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.813
InChIKey:VFXMJJWYOIGKOM-UHFFFAOYSA-N
ID: 85620
SMILES:c1c(CCCCC)cc(O)c2c1OC1(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.812
InChIKey:XVDFALJGKDAGKO-UHFFFAOYSA-N
ID: 85621
SMILES:C1c2c(cc(CCCC)cc2O)OC(C)(C)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -18.094
InChIKey:CDWSIQMUHSUQMF-UHFFFAOYSA-N
ID: 85622
SMILES:C(C(OC(C=CCCCCCCC)=O)CC(C)(O)C1Oc2cc(C)c(O)cc2C1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -16.197
InChIKey:XXRDMIUFOBFLMD-UHFFFAOYSA-N
ID: 85623
SMILES:C(CC)CCCc1c(O)c2c3c(c1)OC(C)(C)C1C3C2C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.578
InChIKey:OJMXSIOHAANQJH-UHFFFAOYSA-N
ID: 85624
SMILES:C(=CCCC(C1=CC(O)C(C)(C)O1)=C)C(C)=CCc1c(O)c(C)cc(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.167
InChIKey:VJSDWUFGZGHWNV-UHFFFAOYSA-N
ID: 85625
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2ccccc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -17.752
InChIKey:CJFQORFGFVBCSD-UHFFFAOYSA-N
ID: 85626
SMILES:C1=C(C)COC2(O)C(C1)c1c(cc(CCCCC)cc1O)OC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.592
InChIKey:PAIAJXLOMODWGA-UHFFFAOYSA-N
ID: 85627
SMILES:CC1(C)C2C(C=C(C)CC2)c2c(cc(C(C)CO)c(O)c2OC)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.183
InChIKey:DBGITJNFFGAFFD-UHFFFAOYSA-N
ID: 85628
SMILES:C1=CCC2(C)C(O)C1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.917
InChIKey:GOVJJMICLYFFLH-UHFFFAOYSA-N
ID: 85629
SMILES:C(CCCCC)Cc1cc(O)c2c(c1)OC(CCC=C(CCC=C(C)C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -16.714
InChIKey:FDFXWIUEDPDKTL-UHFFFAOYSA-N
ID: 85630
SMILES:C(=O)(O)C1=CC2C(CC1)C(C)(C)Oc1c(c(OC)cc(C)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.041
InChIKey:ZKLKSGWAFJTIRR-UHFFFAOYSA-N
ID: 85631
SMILES:C1C2C(C)(CCC3CC(C)(C)CC=C13)C(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -13.197
InChIKey:BWSSHIRTBRJNLF-UHFFFAOYSA-N
ID: 85632
SMILES:O1C2(C)C(CC(O)C(C)(C)Oc3c2c(O)cc(CCC)c3)C2(O)C1(C)CCC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.929
InChIKey:BJQAUYCKEJOIAK-UHFFFAOYSA-N
ID: 85633
SMILES:O1c2cc(CCCCC)c(O)c(C(C(C)C)=O)c2OC2(C)CCC3C(C)(C)CC3C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.573
InChIKey:ZDKFWZLFOLHDFT-UHFFFAOYSA-N
ID: 85634
SMILES:C(c1c(O)c(CC=C(C)CCCC(C)(O)C)cc(OC)c1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.411
InChIKey:QIJNSUSTWLVXOI-UHFFFAOYSA-N
ID: 85635
SMILES:C1(C)(C)Oc2c(c(O)c(C(=O)OCCC)c(Cc3ccccc3)c2O)C2(C)C1CC=C(C)C2CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.694
CB1 binding score: -16.879
InChIKey:SJCDBYGRLZBDIH-UHFFFAOYSA-N
ID: 85636
SMILES:C(CCC(C)=CCC)c1cc(O)c2c(c1)OC(C(C)(C)O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -12.261
InChIKey:DUBRSBQFGCLZLT-UHFFFAOYSA-N
ID: 85637
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3O)C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.997
InChIKey:SFQKGBNHUNHRAM-UHFFFAOYSA-N
ID: 85638
SMILES:C12(C)C(CC3O1)C(CO)(C)CCCC3(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -15.21
InChIKey:COBLAHNOSSGTKP-UHFFFAOYSA-N