ID: 30997
SMILES:CC(C(O)C)CC(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.148
InChIKey:QHLRAPMEVZDISN-UHFFFAOYSA-N
ID: 30998
SMILES:O1C2(c3c(O)cc(C)cc31)CC=C(C)CCC=C(CCC=C(C)C)C(=O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -15.578
InChIKey:KBBLNVKMIOBRFH-UHFFFAOYSA-N
ID: 30999
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C(O)CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.072
InChIKey:DJCKLUPKZRLTPE-UHFFFAOYSA-N
ID: 31000
SMILES:c1c(OCCCC)cc2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.299
InChIKey:YGXJYNYQBFEFCO-UHFFFAOYSA-N
ID: 31001
SMILES:C=C(C1CCC(C)CC1c1c(O)c(C(=O)O)cc(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.934
InChIKey:ZSFBXIDHKOZZEP-UHFFFAOYSA-N
ID: 31002
SMILES:Oc1c(CCCC)c(O)c2c(c1)C1C(C(=C)C)CC=C(C)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.335
InChIKey:TYSHTGJKFNYMBL-UHFFFAOYSA-N
ID: 31003
SMILES:C(=O)(CC(OO)CCC(C)=CC(=O)c1c2c(ccc1O)OC(C)(C)C1CC=C(C)C1C2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.552
CB1 binding score: -13.658
InChIKey:JLTJUVFAGFLGHD-UHFFFAOYSA-N
ID: 31004
SMILES:Oc1c(C=O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.321
InChIKey:CMBFQSLUVVLKBC-UHFFFAOYSA-N
ID: 31005
SMILES:c1(O)cc(CCCCC)cc2c1C1C(CCC(COC)=C1)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.96
InChIKey:NQKFXAQWUDPDRD-UHFFFAOYSA-N
ID: 31006
SMILES:c1(CCCCC)cc(OC)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 31007
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.729
InChIKey:GIIVGKMZIUKMMN-UHFFFAOYSA-N
ID: 31008
SMILES:C(=Cc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)=CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -15.387
InChIKey:HLNRKQKFPDKZST-UHFFFAOYSA-N
ID: 31009
SMILES:O(c1c(CC=C(C)CCC=C(C)C)cc(O)cc1C(C(CCC)=O)CC(C)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -16.287
InChIKey:SPQRCZBQYTVVGY-UHFFFAOYSA-N
ID: 31010
SMILES:c1(OC)cc(C)ccc1OCC1OC(Oc2c(OC(C)=O)c3c(cc2O)OC(C)(C)C2C3C=C(C)CC2)C(O)C(O)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 600.661
CB1 binding score: -16.874
InChIKey:AXDISUHGRMLPER-UHFFFAOYSA-N
ID: 31011
SMILES:C(Cc1c(O)cc(CCCCC)cc1O)=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 31012
SMILES:C(=CC)(C)C(=O)c1c(O)c(C=O)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.154
InChIKey:ISUJJLOXTLBVSB-UHFFFAOYSA-N
ID: 31013
SMILES:C(C=Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C(O)=O)=CC21)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -11.865
InChIKey:RNCGHXXOHUFZDE-UHFFFAOYSA-N
ID: 31014
SMILES:C(CCCC(C)=CCCC(C)=CCc1c(O)cc(CCc2cc(O)cc(OC)c2)c(O)c1)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -18.738
InChIKey:RJAQQLOVYZHJDO-UHFFFAOYSA-N
ID: 31015
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 31016
SMILES:C(CCC)=Cc1cc(OC)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.482
InChIKey:PXOGVQOPPCHULM-UHFFFAOYSA-N
ID: 31017
SMILES:c12c(c(CCCCC(C)OC)cc(O)c1)COC(C)(C)CC=CC(C)=C(O)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.131
InChIKey:YFNNSDMQYJQTCL-UHFFFAOYSA-N