ID: 55630
SMILES:C12(C)CCCC(C)(C)C1C=CC(C)=C2COc1c(OC)cc(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.409
InChIKey:XZZXUCGBOCPIPG-UHFFFAOYSA-N
ID: 55631
SMILES:O=C1C=C(C)CC2C1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.035
InChIKey:KEAXRVVDSBXMMT-UHFFFAOYSA-N
ID: 55632
SMILES:CC1(C)C(CCC(CCCC(CCCC2=CCN(CCc3ccc(O)c(O)c3)C2=O)C)C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 457.655
CB1 binding score: -14.206
InChIKey:NUHCQGHMAOPUEN-UHFFFAOYSA-N
ID: 55633
SMILES:c1(O)cc(CCCCC)c(C=O)c2c1C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.591
InChIKey:SAFMODUFVSRGND-UHFFFAOYSA-N
ID: 55634
SMILES:C(CCCCC)CCCCCCCCCCc1cc(OC)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.793
CB1 binding score: -16.202
InChIKey:AOBMTYIUVQBHCO-UHFFFAOYSA-N
ID: 55635
SMILES:O(Cc1c2c3c(cc1O)OC(C)(C)C1C3C(C(C)CCCC(C)=C)CC1C(C)(C)OC2=O)Cc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.721
CB1 binding score: -15.763
InChIKey:YZBMZNTVFWVBJU-UHFFFAOYSA-N
ID: 55636
SMILES:C=C1CC2c3c(O)cc(C)cc3OC(C)(CCC=C(C)C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.082
InChIKey:XYZKOGSJJFXBSO-UHFFFAOYSA-N
ID: 55637
SMILES:C(c1c(O)c2c(cc1O)OC(CCC=C(C)C)(C)C=C2)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.369
InChIKey:SWYMGQXYIANPPR-UHFFFAOYSA-N
ID: 55638
SMILES:CC(C(O)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.783
InChIKey:ODESPTPXLZERRQ-UHFFFAOYSA-N
ID: 55639
SMILES:C1C(C)=CC(CC(=CCCC(=CCc2c(O)c(C)cc(O)c2)C)C)OC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -15.151
InChIKey:OQFCCUGSDVVITR-UHFFFAOYSA-N
ID: 55640
SMILES:CC(OC)(C)C(C(OC(C=C(C)C)CC=C(C)C)c1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.731
CB1 binding score: -15.421
InChIKey:GOJCFDYTLDBNDY-UHFFFAOYSA-N
ID: 55641
SMILES:c1(OC(C)=O)cc(CCCCC)cc(O)c1C1=C(O)C(C)(C)OC1(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -14.534
InChIKey:HLDTVXJEDYYIPP-UHFFFAOYSA-N
ID: 55642
SMILES:CC(C=C)(CCc1cc(O)ccc1C1(C)CC(O)C(O)C(C)(C)O1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.455
CB1 binding score: -15.62
InChIKey:QUKJVYQYIFOGAB-UHFFFAOYSA-N
ID: 55643
SMILES:CC12CCCC(C)=C1Cc1c(c(O)ccc1O)CC(C)(CCC=C(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.672
InChIKey:WKQGJFWNGPMTER-UHFFFAOYSA-N
ID: 55644
SMILES:c1(OC)c(O)c2c3c(c1C)OC(C)(C)C1CCC(C)(C2=CC=C(C)C1)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -13.726
InChIKey:HLJZROFCBLRSTI-UHFFFAOYSA-N
ID: 55645
SMILES:c12c(O)cc(CC)cc1OC(C)(C)C1C2C=C(COC(=O)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.818
InChIKey:MHFAZVZPSPZIKH-UHFFFAOYSA-N
ID: 55646
SMILES:C(C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(O)cc12)OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.868
InChIKey:SPHAFKUHOUHKAQ-UHFFFAOYSA-N
ID: 55647
SMILES:C1C(C)=CCCC(C)=CCC(C(C)C)=CC(C(=O)C2(C)Oc3c(c(O)cc(CCCCC)c3)C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.717
CB1 binding score: -14.935
InChIKey:IIODWRUVLFODHK-UHFFFAOYSA-N
ID: 55648
SMILES:c1(OC)c2c(cc(CCCC)c1)OC(C)(C)C1=CCC(C)CC21O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.002
InChIKey:UDEKDZYZHXAJJU-UHFFFAOYSA-N
ID: 55649
SMILES:C(=C)(C1C(c2c(O)cc(CCCC)cc2)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -19.478
InChIKey:UELYWRAKVJEDIL-UHFFFAOYSA-N
ID: 55650
SMILES:C(CC=C(C)C)C(=CCc1c(O)cc(O)cc1CCCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N