ID: 13588
SMILES:C(CCCC)c1cc(O)c(CC=C(C)CC=CC(C)=C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.249
InChIKey:ZSGQBNMIBMJDBC-UHFFFAOYSA-N
ID: 13589
SMILES:CC1(O)C(C)=CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3OC)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.332
InChIKey:KCRGIZYHUAHWDV-UHFFFAOYSA-N
ID: 13590
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 13591
SMILES:O(C)c1cc(CC(C23CC(CC=C2COC(=O)C)C(C)(C)O3)C=O)cc(O)c1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.486
CB1 binding score: -18.543
InChIKey:FIHUERBAQORODU-UHFFFAOYSA-N
ID: 13592
SMILES:C1(C)(C)C(c2c(O)cc(COC(=O)CCCCCCCCCCC)cc2)=C(C)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.657
CB1 binding score: -15.205
InChIKey:XQCSZQKUDGOUKR-UHFFFAOYSA-N
ID: 13593
SMILES:C1=C(CCCCC)CC2C(C)(C=CC(=O)OC2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.42
CB1 binding score: -15.306
InChIKey:FHTSDTFBNYCFPT-UHFFFAOYSA-N
ID: 13594
SMILES:C1CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2)CC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.394
InChIKey:RBRTZLBKEHSIEX-UHFFFAOYSA-N
ID: 13595
SMILES:CC1(C)C2CCC(CO)=CC2c2c(O)cc(CCc3ccc(O)cc3)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -15.786
InChIKey:IYMVRODPFMBGFL-UHFFFAOYSA-N
ID: 13596
SMILES:C1=C(C)CCC12C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.92
InChIKey:YXXGSTUGCOBTIA-UHFFFAOYSA-N
ID: 13597
SMILES:COc1c(O)c(O)c2c(c1CCC(C)=O)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.526
InChIKey:JCDKUHHJHQEWQV-UHFFFAOYSA-N
ID: 13598
SMILES:CC1C(=O)C2=C(C(OC)C1)C(C)(CCC=C(C)C)OC2c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.736
InChIKey:QLXPCAVUZJGGDF-UHFFFAOYSA-N
ID: 13599
SMILES:C1CC2(C(C)CC(O)CC2(C)CO)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -15.298
InChIKey:ZWJPFNXLGJTHMO-UHFFFAOYSA-N
ID: 13600
SMILES:c1c(CCCCC)cc2c(c1O)C1C(CC(OC(=O)C)C2(C)C)C2(OC(=O)C(C)=C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.525
CB1 binding score: -16.015
InChIKey:VZSIDOKSJZEYTJ-UHFFFAOYSA-N
ID: 13601
SMILES:C1(C)(O)C2CC(C(C)=C)(CC1)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.524
InChIKey:RQGFREYUGIGMOD-UHFFFAOYSA-N
ID: 13602
SMILES:C1=C2C(C(O)C1C(C)C)OC(c1c(O)cc(CCCC)cc1O)C=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -11.593
InChIKey:ACMRWQNNVUVSHF-UHFFFAOYSA-N
ID: 13603
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 13604
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 13605
SMILES:O1c2cc(CCCCC)c(C(=O)O)c(O)c2CC2C1(C)CCC(C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -13.457
InChIKey:WOCQPFBLXAGTPM-UHFFFAOYSA-N
ID: 13606
SMILES:C(OC(=O)C)C1(C)CC2C3(Oc4c(c(O)cc(CCCCC)c4)C3)C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.605
InChIKey:SNAUKHJEMRYJOU-UHFFFAOYSA-N
ID: 13607
SMILES:C(CC(C)C)Cc1cc(O)c2c(c1)C1C(CCC2=O)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.262
InChIKey:FTUFVFNFQQDQCX-UHFFFAOYSA-N
ID: 13608
SMILES:C1CC(O)C(C)C2C1C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.467
InChIKey:ZQUQEPPAXXDBTG-UHFFFAOYSA-N